Detailed information for compound 629240

Basic information

Technical information
  • TDR Targets ID: 629240
  • Name: 2-[(5-chlorothiophene-2-carbonyl)amino]-5,6-d ihydro-4H-cyclopenta[d]thiophene-3-carboxamid e
  • MW: 326.822 | Formula: C13H11ClN2O2S2
  • H donors: 2 H acceptors: 2 LogP: 3.86 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(s1)C(=O)Nc1sc2c(c1C(=O)N)CCC2
  • InChi: 1S/C13H11ClN2O2S2/c14-9-5-4-8(19-9)12(18)16-13-10(11(15)17)6-2-1-3-7(6)20-13/h4-5H,1-3H2,(H2,15,17)(H,16,18)
  • InChiKey: RUMOKXYHJBBBIB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[(5-chloro-2-thienyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[d]thiophene-3-carboxamide
  • 2-[(5-chlorothiophen-2-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[d]thiophene-3-carboxamide
  • IVK/0029045
  • Oprea1_402570
  • ZINC04070274

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.3318 0.3318
Treponema pallidum NADH oxidase 0.0017 0 0.5
Schistosoma mansoni hypothetical protein 0.0034 0.1217 0.1282
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0162 1 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.1318 1
Loa Loa (eye worm) TAR-binding protein 0.0065 0.3318 0.2849
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0689 0.0036
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.2183 0.2985
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0017 0 0.5
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0123 0.7313 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1318 1
Echinococcus granulosus tar DNA binding protein 0.0065 0.3318 0.3318
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3318 0.3494
Loa Loa (eye worm) RNA binding protein 0.0065 0.3318 0.2849
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.1318 0.1318
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3318 0.3494
Schistosoma mansoni alpha glucosidase 0.0036 0.1318 0.1388
Echinococcus multilocularis musashi 0.0027 0.0689 0.0689
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.1318 0.1318
Echinococcus granulosus lamin dm0 0.0027 0.0689 0.0689
Brugia malayi glutathione reductase 0.0048 0.2183 0.2183
Mycobacterium tuberculosis Probable dehydrogenase 0.011 0.6463 0.8837
Echinococcus multilocularis tar DNA binding protein 0.0065 0.3318 0.3318
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.3318 0.2849
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.2316 0.2316
Mycobacterium tuberculosis Probable reductase 0.011 0.6463 0.8837
Plasmodium falciparum glutathione reductase 0.0048 0.2183 1
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0017 0 0.5
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.2183 0.2183
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0123 0.7313 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.011 0.6463 0.8837
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0689 0.0036
Trichomonas vaginalis maltase-glucoamylase, putative 0.0036 0.1318 1
Toxoplasma gondii thioredoxin reductase 0.0048 0.2183 1
Leishmania major trypanothione reductase 0.0048 0.2183 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1318 0.6038
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3318 0.3494
Schistosoma mansoni alpha-glucosidase 0.0139 0.8446 0.8894
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1318 0.6038
Echinococcus granulosus lysosomal alpha glucosidase 0.0162 1 1
Schistosoma mansoni lamin 0.0027 0.0689 0.0726
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0017 0 0.5
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.1318 0.6038
Echinococcus multilocularis lamin 0.0027 0.0689 0.0689
Trypanosoma brucei glucosidase, putative 0.0036 0.1318 0.6038
Loa Loa (eye worm) glutathione reductase 0.0048 0.2183 0.1635
Mycobacterium tuberculosis Putative ferredoxin reductase 0.011 0.6463 0.8837
Loa Loa (eye worm) hypothetical protein 0.005 0.2316 0.1777
Schistosoma mansoni alpha-glucosidase 0.0139 0.8446 0.8894
Echinococcus granulosus intermediate filament protein 0.0027 0.0689 0.0689
Plasmodium falciparum thioredoxin reductase 0.0048 0.2183 1
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.2183 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1318 1
Schistosoma mansoni lamin 0.0027 0.0689 0.0726
Brugia malayi RNA binding protein 0.0065 0.3318 0.3318
Giardia lamblia NADH oxidase lateral transfer candidate 0.0017 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0027 0.0689 0.0036
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1318 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.011 0.6463 0.8837
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3318 0.3494
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1318 1
Brugia malayi Thioredoxin reductase 0.0048 0.2183 0.2183
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.1318 0.0709
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.011 0.6463 0.8837
Trichomonas vaginalis sucrase-isomaltase, putative 0.0036 0.1318 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.2183 0.2183
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0017 0 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.2316 0.2316
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.1318 0.1318
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.1318 0.5
Plasmodium vivax glutathione reductase, putative 0.0048 0.2183 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.1318 1
Trypanosoma brucei trypanothione reductase 0.0048 0.2183 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0123 0.7313 1
Onchocerca volvulus 0.0093 0.5296 1
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.2183 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.1318 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.1318 1
Echinococcus granulosus lamin 0.0027 0.0689 0.0689
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0689 0.0689
Schistosoma mansoni tar DNA-binding protein 0.0065 0.3318 0.3494
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 1 1
Leishmania major alpha glucosidase II subunit, putative 0.0036 0.1318 0.6038
Echinococcus multilocularis lamin dm0 0.0027 0.0689 0.0689
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0123 0.7313 1
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.1217 0.1217
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.2183 0.1635
Brugia malayi intermediate filament protein 0.0027 0.0689 0.0689
Brugia malayi TAR-binding protein 0.0065 0.3318 0.3318
Schistosoma mansoni intermediate filament proteins 0.0027 0.0689 0.0726
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.2316 0.1777
Loa Loa (eye worm) hypothetical protein 0.0034 0.1217 0.0601

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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